Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium channel protein type 9 subunit alpha' and Ligand = 'BDBM50164032'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM50164032 (CHEMBL361169 | N*1*-[2,2'']Bithiophenyl-5-ylmethyl...) Show SMILES CC(C)(CC(=O)NCc1ccc(cc1)-c1ccccc1S(N)(=O)=O)C(=O)NCc1ccc(s1)-c1cccs1 Show InChI InChI=1S/C28H29N3O4S3/c1-28(2,27(33)31-18-21-13-14-24(37-21)23-7-5-15-36-23)16-26(32)30-17-19-9-11-20(12-10-19)22-6-3-4-8-25(22)38(29,34)35/h3-15H,16-18H2,1-2H3,(H,30,32)(H,31,33)(H2,29,34,35)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory concentration against voltage-gated sodium channel Nav1.7 in voltage-ion-probe-reader (VIPR) assay				Bioorg Med Chem Lett 15: 1901-7 (2005) Article DOI: 10.1016/j.bmcl.2005.02.002 BindingDB Entry DOI: 10.7270/Q2HH6JMD
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